(E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-methoxy-3-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acrylic acid Formula: C16H16N2O7S2 MolecularWeight: 412.43744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H16N2O7S2/c1-25-14-8-2-11(3-9-16(19)20)10-15(14)27(23,24)18-12-4-6-13(7-5-12)26(17,21)22/h2-10,18H,1H3,(H,19,20)(H2,17,21,22)/b9-3+